N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride
TL;DR: N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride (CAS 81086-02-4) is a chemical compound with molecular formula C21H23ClN2O3 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(diethylamino)ethyl]-9,10-dioxoanthracene-2-carboxamide;hydrochloride
Also Known As: N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride, 2-Anthracenecarboxamide, N-(2-(diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-, monohydrochloride, N-[2-(diethylamino)ethyl]-9,10-dioxoanthracene-2-carboxamide, N-(2-diethylaminoethyl)-9,10-dioxoanthracene-2-carboxamide hydrochloride, N-[2-(Diethylamino)ethyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C21H23ClN2O3 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 2.9554 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.1397 |
| Heavy Atoms | 27 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 81086-02-4 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.Cl |
| InChIKey | YLXMWPUQEQZOCB-UHFFFAOYSA-N |
Product Overview
N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride (CAS 81086-02-4), with molecular formula C21H23ClN2O3 and molecular weight 386.14 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-9,10-dioxoanthracene-2-carboxamide;hydrochloride.
Chemical Property Profile of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride
Property Insights of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride
The XLogP value of 2.9554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride. Following Lipinski's Rule of Five, N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride?
The CAS number of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride is 81086-02-4.
What is the molecular formula of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride?
The molecular formula of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride is C21H23ClN2O3.
What is the molecular weight of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride?
The molecular weight of N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride is 386.14 g/mol.
Where can I buy N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride?
You can request a quote for N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(Diethylamino)ethyl)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.